Trifluorothymine

CAS: 54-20-6

Ref. TR-T793638

Product Information

• Name: Trifluorothymine
• Synonyms: 5-(Trifluoromethyl)-2,4(1H,3H)-pyrimidinedione, 5-(Trifluoromethyl)pyrimidine-2,4-diol, 5-(Trifluoromethyl)uracil, 5-Trifluoromethyl-1H-pyrimidine-2,4-dione, NSC 73757, 2,4(1H,3H)-Pyrimidinedione, 5-(trifluoromethyl)-, 5-(Trifluoromethyl)-1,2,3,4-Tetrahydropyrimidine-2,4-Dione, 5-(trifluoromethyl)-2,4(1H,3H)-Pyrimidinedione, 5-(trifluoromethyl)pyrimidine-2,4(1H,3H)-dione, 5-Trifluoromethyluracil, 5-Trifluorothymine, Uracil, 5-(trifluoromethyl)-
• CAS: 54-20-6

Description

Applications Trifluorothymine is an antitumor and antiviral agent. Trifluorothymine was found in patients’ urine as a metabolite of Trifluorothymidine as cancer treatment.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Cirak, C., et al.: J. Mol. Model., 18, 4453 (2012); Dexter, D., et al.: Cancer Res., 32, 247 (1972)

• Brand: TRC

Chemical properties

• Molecular weight: 180.08
• Formula: C₅H₃F₃N₂O₂
• Color/Form: White to Off-White Solid
• InChI: InChI=1S/C30H48O10/c1-14(4-7-22(32)33)17-5-6-18-16-13-21(31)20-12-15(8-10-30(20,3)19(16)9-11-29(17,18)2)39-28-25(36)23(34)24(35)26(40-28)27(37)38/h14-21,23-26,28,31,34-36H,4-13H2,1-3H3,(H,32,33)(H,37,38)/t14-,15?,16+,17-,18+,19+,20+,21+,23+,24+,25-,26+,28-,29-,30-/m1/s1
• InChI key: InChIKey=YZWLAOJIDABTSJ-RGCTXVDVSA-N
• SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@@H]4CC(O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@@]21C